[Octopus-devel] [Octopus-notify] svn commit: r8943 - in trunk/src: ions by mjv500

David Strubbe dstrubbe at berkeley.edu
Wed Mar 28 19:48:54 WEST 2012


Hi Matthieu,

Looks like most of this is debugging lines you didn't mean to commit.

As for the symmetries, the problem is not that the line you changed assumes
3D, it's that the routines we call to analyze symmetries assume 3D. The
generalization to nD may not be straightforward. Anyway, you can see that
the 4D test is failing after your commit.

Cheers,
David

On Wed, Mar 28, 2012 at 9:44 AM, <octopus-svn at tddft.org> wrote:

>      Author: mjv500
>        Date: Wed Mar 28 17:44:33 2012
> New Revision: 8943
>   Changeset: http://www.tddft.org/trac/octopus/changeset/8943
>
> Modified:
>   trunk/src/grid/mesh_init.F90
>   trunk/src/ions/symmetries.F90
>   trunk/src/ions/xyz_file.F90
>
> Log:
> sym checking was not working for ndim not = 3
> _______________________________________________
> Octopus-notify mailing list
> Octopus-notify at tddft.org
> http://www.tddft.org/mailman/listinfo/octopus-notify
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://www.tddft.org/pipermail/octopus-devel/attachments/20120328/f96c976d/attachment.html>


More information about the Octopus-devel mailing list